(2α,3β,5α,16β)-2-Hydroxy-20-methylene-21-oxo-16,21-epoxypregnan-3-yl β-D-glucopyranosyl-(1->2)-β-D-glucopyranosyl-(1->4)-β-D-galactopyranoside

More details:

• Systematic name

  (2alpha,3beta,5alpha,16beta)-2-Hydroxy-20-methylene-21-oxo-16,21-epoxypregnan-3-yl beta-D-glucopyranosyl-(1->2)-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranoside

• SMILES

  O=C/1O[C@@H]7[C@H](C\1=C)[C@@]8(C)CC[C@H]6[C@@H](CC[C@H]5C[C@@H](O[C@@H]4O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO)[C@H](O)[C@H]4O)[C@H](O)C[C@@]56C)[C@@H]8C7

• Std. InChi

  InChI=1S/C40H62O19/c1-14-25-21(53-35(14)52)9-18-16-5-4-15-8-20(19(44)10-40(15,3)17(16)6-7-39(18,25)2)54-36-32(51)30(49)33(24(13-43)57-36)58-38-34(29(48)27(46)23(12-42)56-38)59-37-31(50)28(47)26(45)22(11-41)55-37/h15-34,36-38,41-51H,1,4-13H2,2-3H3/t15-,16+,17-,18-,19+,20+,21-,22+,23+,24+,25-,26+,27+,28-,29-,30+,31+,32+,33-,34+,36+,37-,38-,39-,40-/m0/s1

• Std. InChIKey

  MAYTXIIGXZPMFA-FDTSWJLHSA-N

• Cite this record

  CSID:8708956, http://www.chemspider.com/Chemical-Structure.8708956.html (accessed 16:02, May 16, 2024)